In-Silico Structure database (LMISSD)
| |
LM ID | LMGP20069AK4 |
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Common Name | PG(14:1(9Z)/4:1(3E)) |
Systematic Name | 1-(9Z-tetradecenoyl)-2-3E-butenoyl-sn-glycero-3-phospho-(1'-sn-glycerol) |
Synonyms | PG(18:2); PG(14:1/4:1) |
Exact Mass | |
Formula | C24H43O10P |
Category | Glycerophospholipids [GP] |
Main Class | Oxidized glycerophospholipids [GP20] |
Sub Class | Oxidized glycerophosphoglycerols [GP2006] |
PubChem Compound ID (CID) | - |
InChIKey | YVNMJBBBXPFBIP-UYRGJFBYSA-N |
InChI | InChI=1S/C24H43O10P/c1-3-5-6-7-8-9-10-11-12-13-14-16-23(27)31-19-22(34-24(28)15- 4-2)20-33-35(29,30)32-18-21(26)17-25/h4,7-8,21-22,25-26H,2-3,5-6,9-20H2,1H3,(H,2 9,30)/b8-7-/t21-,22+/m0/s1 |
SMILES | [H][C@](O)(CO)COP(OC[C@]([H])(OC(CC=C)=O)COC(CCCCCCC/C=C\CCCC)=O)(=O)O |
MS Spectra | - Predict MS/MS spectrum (Neg. mode) |
Status | Active (generated by computational methods) |